Ammonium → HCID 67065198, compound

HRID 1121424Notes

Reaction equation

[CH3:3][O:4][C:5]([CH2:6][c:7]1[cH:8][c:9](-[c:15]2[c:16]([CH3:41])[cH:17][c:18]([C:21]([CH2:22][CH3:23])([c:24]3[cH:25][c:26]([CH3:38])[c:27]([CH:30]=[CH:31][C:32]([CH2:33][CH3:34])([OH:35])[CH2:36][CH3:37])[cH:28][cH:29]3)[CH2:39][CH3:40])[cH:19][cH:20]2)[c:10]([O:13][CH3:14])[cH:11][cH:12]1)=[O:42].[CH3:50][OH:51].[Cl-:43].[NH4+:44].[Na+:2].[O:45]1[CH2:46][CH2:47][CH2:48][CH2:49]1.[OH-:1]>>[O:4]=[C:5]([CH2:6][c:7]1[cH:8][c:9](-[c:15]2[c:16]([CH3:41])[cH:17][c:18]([C:21]([CH2:22][CH3:23])([c:24]3[cH:25][c:26]([CH3:38])[c:27]([CH:30]=[CH:31][C:32]([CH2:33][CH3:34])([OH:35])[CH2:36][CH3:37])[cH:28][cH:29]3)[CH2:39][CH3:40])[cH:19][cH:20]2)[c:10]([O:13][CH3:14])[cH:11][cH:12]1)[OH:42]

Participants

Reactant 7

HCID 8028Tetrahydrofuran

HCID 67065255Methyl 2-[3-[4-[3-[4-(3-ethyl-3-hydroxypent-1-enyl)-3-methylphenyl]pentan-3-yl]-2-methylphenyl]-4-methoxyphenyl]acetate

Product 1

HCID 67065198HCID 67065198, compound

Sources & evidence

ORD record: ord-8fdf83e5c6de46b69065f59a1194fd0d
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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